TSS

2-(1H-INDOL-3-YL)ETHANAMINE

Created:	2005-08-08
Last modified:	2024-09-27

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12 entries where TSS is found as a standalone ligand1 entries where TSS is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	24
Chiral Atom Count	0
Bond Count	25
Aromatic Bond Count	10

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Chemical Component Summary
Name	2-(1H-INDOL-3-YL)ETHANAMINE
Synonyms	TRYPTAMINE
Systematic Name (OpenEye OEToolkits)	2-(1H-indol-3-yl)ethanamine
Formula	C₁₀ H₁₂ N₂
Molecular Weight	160.216
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	c1cccc2c1c(cn2)CCN
SMILES	CACTVS	3.341	NCCc1c[nH]c2ccccc12
SMILES	OpenEye OEToolkits	1.5.0	c1ccc2c(c1)c(c[nH]2)CCN
Canonical SMILES	CACTVS	3.341	NCCc1c[nH]c2ccccc12
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1ccc2c(c1)c(c[nH]2)CCN
InChI	InChI	1.03	InChI=1S/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2
InChIKey	InChI	1.03	APJYDQYYACXCRM-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08653
Name	Tryptamine
Groups	experimental
Synonyms	1H-indole-3-ethanamine 3-(2-Aminoethyl)indole 2-(3-indolyl)ethylamine Tryptamine
Categories	Amines Biogenic Amines Biogenic Monoamines Heterocyclic Compounds, Fused-Ring Indoles
CAS number	61-54-1

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Aralkylamine dehydrogenase light chain	MRWLDKFGESLSRSVAHKTSRRSVLRSVGKLMVGSAFVLPVLPVARAAGG...	unknown
Aralkylamine dehydrogenase heavy chain	MKSKFKLTTAAAMLGLMVLAGGAQAQDKPREVLTGGHSVSAPQENRIYVM...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682